Chem
J-GLOBAL ID：200907085866369351   Nikkaji number：J1.998.474E

Tetrapetalone B

テトラペタロンB
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C28H35NO9
Molecular formula furigana： C28-H35-N-O9
Molecular weight： 529.586
InChI： InChI=1S/C28H35NO9/c1-12-11-27(16(5)37-17(6)30)25(33)14(3)26(34)29(27)21-10-18(31)9-19-24(13(2)23(12)28(19,21)35)38-22-8-7-20(32)15(4)36-22/h9-11,13,15-16,20,22-24,32-33,35H,7-8H2,1-6H3/t13-,15-,16+,20-,22+,23-,24+,27-,28+/m1/s1
InChI key： PDESUVPLPIOXLG-IWMKGNGHSA-N
SMILES： C[C@H](OC(=O)C)[C@@]12C=C(C)[C@@H]3[C@@H](C)[C@H](O[C@H]4CC[C@@H](O)[C@@H](C)O4)C4=CC(=O)C=C(N1C(=O)C(=C2O)C)[C@]34O
Systematic name  (3)：
  • (2R)-2-[(S)-1-アセトキシエチル]-4,5β,11-トリメチル-6α-(2,3,6-トリデオキシ-β-D-threo-ヘキソピラノシルオキシ)-9bβ,10-ジヒドロキシ-2α,1-プロペノ-2,4aβ,5,6,8,9b-ヘキサヒドロ-1H-インデノ[7,1-bc]アゼピン-8,12-ジオン
  • (1S)-1-[(6R,9S,10R,11S,16S)-5,16-ジヒドロキシ-11-{[(2R,5R,6R)-5-ヒドロキシ-6-メチルオキサン-2-イル]オキシ}-4,8,10-トリメチル-3,14-ジオキソ-2-アザテトラシクロ[7.6.1.02,6.012,16]ヘキサデカ-1(15),4,7,12-テトラエン-6-イル]エチル アセタート
  • (1S)-1-[(6R,9S,10R,11S,16S)-5,16-dihydroxy-11-{[(2R,5R,6R)-5-hydroxy-6-methyloxan-2-yl]oxy}-4,8,10-trimethyl-3,14-dioxo-2-azatetracyclo[7.6.1.02,6.012,16]hexadeca-1(15),4,7,12-tetraen-6-yl]ethyl acetate
Other name (3)：
  • (2R)-2-[(S)-1-Acetoxyethyl]-4,5β,11-trimethyl-6α-(2,3,6-trideoxy-β-D-threo-hexopyranosyloxy)-9bβ,10-dihydroxy-2α,1-propeno-2,4aβ,5,6,8,9b-hexahydro-1H-indeno[7,1-bc]azepine-8,12-dione
  • テトラペタロンB
  • Tetrapetalone B
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM